Wednesday, January 20, 2010

Electronic correlations in cerium oxides

Today, Elvis Shoko had his Ph.D oral exam. He passed! Congratulations, Elvis!
I thought his talk before the interview with the assessors was a nice summary of his thesis.

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Quantum justification for classical discussions of potential energy surfaces

 In computational quantum chemistry, the Born-Oppenheimer approximation (BOA) is used to determine potential energy surfaces (PES) for elect...